Information card for entry 2006939

Structure parameters

• Formula: C21 H18 F10 N O3 P
• Calculated formula: C21 H18 F10 N O3 P
• SMILES: P(=O)([O-])(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F.O=C1CC([NH2+]C(C1)(C)C)(C)C
• Title of publication: 2,2,6,6-Tetramethyl-4-oxopiperidinium Bis(pentafluorophenyl)phosphinate
• Authors of publication: Charles F. Campana; Katherine W. Oliver; Steven J. Rettig; Robert C. Thompson; James Trotter; Shihua Xia
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 1
• Pages of publication: 99 - 101
• a: 11.845 ± 0.001 Å
• b: 14.149 ± 0.001 Å
• c: 14.766 ± 0.001 Å
• α: 90.206 ± 0.007°
• β: 108.131 ± 0.005°
• γ: 91.112 ± 0.005°
• Cell volume: 2351.3 ± 0.3 ų
• Cell temperature: 193.2 K
• Ambient diffraction temperature: 193.2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for all reflections included in the refinement: 0.112
• Goodness-of-fit parameter for all reflections included in the refinement: 2.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No